UCSF

ZINC00383605

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 16 Yes

Popular Name: benzoic acid, 4-methylphenyl ester benzoic acid, 4-methylphenyl ester

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.02 9.68 -5.89 0 2 0 26 218.296 3 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP1016670A1; US5840684; US5843889 IBM Patent Data

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